SCHEMBL21399641

SCHEMBL21399641

Cc1cccc(Cc2c[nH]c3ccccc23)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.68
KMT2A Q03164 2/20 0.68
GPR84 Q9NQS5 3/20 0.61
AHR P35869 2/20 0.61
MAPT P10636 2/20 0.61
CYP3A4 P08684 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
HTR6 P50406 1/20 0.56
PTPN1 P18031 2/20 0.54
PCSK9 Q8NBP7 2/20 0.50
HTT P42858 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
HTR1A P08908 1/20 0.50
HTR2A P28223 1/20 0.50
CDK4 P11802 1/20 0.50
CCND1 P24385 1/20 0.50
LMNA P02545 1/20 0.50
GAA P10253 1/20 0.50
BCHE P06276 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31744760 0.82 GPR84 (0.65) KMT2AGPR84HTR1AHTR2A
SCHEMBL3086792 0.82 MEN1 (0.74) MEN1KMT2AGPR84AHRMAPT
SCHEMBL553605 0.81 MEN1 (1.00) MEN1KMT2AGPR84AHRMAPT
SCHEMBL30648199 0.81 MEN1 (1.00) MEN1KMT2AGPR84AHRMAPT
SCHEMBL21399662 0.81 MEN1 (0.68) MEN1KMT2AGPR84AHRMAPT
SCHEMBL21399587 0.81 MEN1 (0.68) MEN1KMT2AGPR84AHRMAPT
SCHEMBL21399633 0.81 GPR84 (0.68) MEN1KMT2AGPR84AHRMAPT
SCHEMBL2949308 0.81 HTR6 (0.69) MEN1KMT2AGPR84AHRMAPT
SCHEMBL26636447 0.81 GPR84 (0.70) MEN1KMT2AGPR84AHRMAPT
SCHEMBL31744749 0.81 GPR84 (0.70) MEN1KMT2AGPR84AHRMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019183527-A1 OXIDIZED BIS(3-INDOLYL)METHANES AND USES THEREOF Sanford Burnham Prebys Medical Discovery Institute (US) 2019-09-26 WO disclosed